SCHEMBL2903635

SCHEMBL2903635

CCCCCCOC(=O)C=CC#N.CCCCCOC(=O)C=CC#N

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.64
ATM Q13315 1/20 0.60
NAAA Q02083 1/20 0.48
APP P05067 4/20 0.48
TSHR P16473 3/20 0.47
HPGD P15428 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
EPHX1 P07099 1/20 0.46
PRKCA P17252 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8380051 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL29892 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL35541 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL1452757 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL3457992 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL29341 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL15229292 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL2906298 1.00 HCAR2 (0.64) HCAR2ATMNAAAAPPTSHR
SCHEMBL19579380 0.98 ATM (0.63) HCAR2ATMNAAAAPPTSHR
SCHEMBL6465406 0.98 ATM (0.63) HCAR2ATMNAAAAPPTSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130089505-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE VALOR MEDICAL, INC. (US) 2013-04-11 US disclosed
EP-2219553-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE Valor Medical, Inc. (US) 2010-08-25 EP disclosed
US-20090257976-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE VALOR MEDICAL, INC. (US) 2009-10-15 US disclosed
WO-2009064698-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE VALOR MEDICAL, INC. (US) 2009-05-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130089505-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE MMAB, CBL, ECPAS HCAR2 781/4885ATM 652/4885NAAA 1050/4885
US-20090257976-A1 SINGLE VIAL FORMULATION FOR MEDICAL GRADE CYANOACRYLATE MMAB, CBL, ECPAS HCAR2 781/4885ATM 652/4885NAAA 1050/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.